U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C16H21BrO2
Molecular Weight 325.241
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CYMOPOL

SMILES

CC(C)=CCC\C(C)=C\CC1=CC(O)=C(Br)C=C1O

InChI

InChIKey=IUFDABCKTYWJDR-KPKJPENVSA-N
InChI=1S/C16H21BrO2/c1-11(2)5-4-6-12(3)7-8-13-9-16(19)14(17)10-15(13)18/h5,7,9-10,18-19H,4,6,8H2,1-3H3/b12-7+

HIDE SMILES / InChI

Molecular Formula C16H21BrO2
Molecular Weight 325.241
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:39:16 GMT 2023
Edited
by admin
on Sat Dec 16 12:39:16 GMT 2023
Record UNII
RQK9B56VQH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
CYMOPOL
Common Name English
2-Bromo-5-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-1,4-benzenediol
Systematic Name English
1,4-Benzenediol, 2-bromo-5-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-
Systematic Name English
NSC-615493
Code English
1,4-Benzenediol, 2-bromo-5-(3,7-dimethyl-2,6-octadienyl)-, (E)-
Systematic Name English
Code System Code Type Description
CAS
62008-14-4
Created by admin on Sat Dec 16 12:39:16 GMT 2023 , Edited by admin on Sat Dec 16 12:39:16 GMT 2023
PRIMARY
NSC
615493
Created by admin on Sat Dec 16 12:39:16 GMT 2023 , Edited by admin on Sat Dec 16 12:39:16 GMT 2023
PRIMARY
FDA UNII
RQK9B56VQH
Created by admin on Sat Dec 16 12:39:16 GMT 2023 , Edited by admin on Sat Dec 16 12:39:16 GMT 2023
PRIMARY
PUBCHEM
5386672
Created by admin on Sat Dec 16 12:39:16 GMT 2023 , Edited by admin on Sat Dec 16 12:39:16 GMT 2023
PRIMARY